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CAS 898764-02-8

:

Ethyl 2-[(2,5-dihydro-1H-pyrrol-1-yl)methyl]-ζ-oxobenzeneheptanoate

Description:
Ethyl 2-[(2,5-dihydro-1H-pyrrol-1-yl)methyl]-ζ-oxobenzeneheptanoate, with the CAS number 898764-02-8, is a chemical compound characterized by its complex structure, which includes an ethyl ester functional group and a pyrrole moiety. This compound features a benzene ring substituted with a heptanoate chain, contributing to its lipophilicity and potential biological activity. The presence of the pyrrolidine ring suggests possible interactions with biological systems, potentially influencing its pharmacological properties. Ethyl esters are generally known for their pleasant odors and are often used in flavoring and fragrance applications. The specific arrangement of functional groups in this compound may impart unique reactivity and solubility characteristics, making it of interest in medicinal chemistry and organic synthesis. Additionally, the compound's molecular weight, boiling point, and solubility in various solvents would be relevant for practical applications, although these specific properties would need to be determined experimentally or sourced from chemical databases. Overall, this compound represents a fascinating intersection of organic chemistry and potential therapeutic applications.
Formula:C20H27NO3
InChI:InChI=1S/C20H27NO3/c1-2-24-20(23)13-5-3-4-12-19(22)18-11-7-6-10-17(18)16-21-14-8-9-15-21/h6-11H,2-5,12-16H2,1H3
InChI key:InChIKey=FYZBOOYRPLUDBD-UHFFFAOYSA-N
SMILES:C(CCCCCC(OCC)=O)(=O)C1=C(CN2CC=CC2)C=CC=C1
Synonyms:
  • Ethyl 2-[(2,5-dihydro-1H-pyrrol-1-yl)methyl]-ζ-oxobenzeneheptanoate
  • Benzeneheptanoic acid, 2-[(2,5-dihydro-1H-pyrrol-1-yl)methyl]-ζ-oxo-, ethyl ester
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